| Properties | Image |
|---|
| MNX_ID | MNXM191438 |
 |
| reference | slm:000164230 |
| formula | C56H100O6 |
| global charge | 0 |
| mol weight | 869.41 |
| InChIKey | ROSJDPOEKLUTEP-OBLNZMCNSA-N |
| InChI | InChI=1S/C56H100O6/c1-5-7-9-11-13-15-17-19-21-22-24-26-28-32-37-41-45-49-56(59)62-53(51-61-55(58)48-44-40-36-33-29-30-34-38-42-46-52(3)4)50-60-54(57)47-43-39-35-31-27-25-23-20-18-16-14-12-10-8-6-2/h13,15-16,18-19,21,24,26,52-53H,5-12,14,17,20,22-23,25,27-51H2,1-4H3/b15-13-,18-16+,21-19-,26-24-/t53-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC/C=C/CCCCCC)COC(=O)CCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C56H100O6/c1-5-7-9-11-13-15-17-19-21-22-24-26-28-32-37-41-45-49-56(59)62-53(51-61-55(58)48-44-40-36-33-29-30-34-38-42-46-52(3)4)50-60-54(57)47-43-39-35-31-27-25-23-20-18-16-14-12-10-8-6-2/h13,15-16,18-19,21,24,26,52-53H,5-12,14,17,20,22-23,25,27-51H2,1-4H3/b15-13-,18-16+,21-19-,26-24-/t53-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:21]\[CH2:22]/[CH:24]=[CH:26]\[CH2:28][CH2:32][CH2:37][CH2:41][CH2:45][CH2:49][C:56](=[O:59])[O:62][C@H:53]([CH2:50][O:60][C:54]([CH2:47][CH2:43][CH2:39][CH2:35][CH2:31][CH2:27][CH2:25][CH2:23][CH2:20]/[CH:18]=[CH:16]/[CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:57])[CH2:51][O:61][C:55]([CH2:48][CH2:44][CH2:40][CH2:36][CH2:33][CH2:29][CH2:30][CH2:34][CH2:38][CH2:42][CH2:46][CH:52]([CH3:3])[CH3:4])=[O:58] |
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